CID 129980991

Tert-butyl 4-amino-9-oxa-1-azaspiro[5.5]undecane-1-carboxylate

Structural Information

Molecular Formula
C14H26N2O3
SMILES
CC(C)(C)OC(=O)N1CCC(CC12CCOCC2)N
InChI
InChI=1S/C14H26N2O3/c1-13(2,3)19-12(17)16-7-4-11(15)10-14(16)5-8-18-9-6-14/h11H,4-10,15H2,1-3H3
InChIKey
IHCKELKDPBJMHS-UHFFFAOYSA-N
Compound name
tert-butyl 4-amino-9-oxa-1-azaspiro[5.5]undecane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.19434 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.20162 165.7
[M+Na]+ 293.18356 168.5
[M-H]- 269.18706 168.7
[M+NH4]+ 288.22816 181.0
[M+K]+ 309.15750 168.6
[M+H-H2O]+ 253.19160 158.9
[M+HCOO]- 315.19254 177.8
[M+CH3COO]- 329.20819 196.9
[M+Na-2H]- 291.16901 169.0
[M]+ 270.19379 159.5
[M]- 270.19489 159.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.